Information card for entry 4085395

Structure parameters

• Common name: 3 in manuscript
• Formula: C19 H32 F6 Li N4 O P
• Calculated formula: C19 H32 F6 Li N4 O P
• Title of publication: Lithium Complexes of Neutral Bis-NHC Ligands
• Authors of publication: Brendel, Matthias; Wenz, Jan; Shishkov, Igor V.; Rominger, Frank; Hofmann, Peter
• Journal of publication: Organometallics
• Year of publication: 2015
• Journal volume: 34
• Journal issue: 3
• Pages of publication: 669
• a: 11.4626 ± 0.0006 Å
• b: 14.2987 ± 0.0008 Å
• c: 14.8866 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2439.9 ± 0.2 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 7
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.1096
• Residual factor for significantly intense reflections: 0.0835
• Weighted residual factors for significantly intense reflections: 0.1465
• Weighted residual factors for all reflections included in the refinement: 0.1543
• Goodness-of-fit parameter for all reflections included in the refinement: 1.212
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No